![N-[2-methoxy-4-({[(2E)-3-phenylprop-2-enoyl]carbamothioyl}amino)phenyl]-1-benzofuran-2-carboxamide structure](/static/products/4296/429651-39-8.webp)
N-[2-methoxy-4-({[(2E)-3-phenylprop-2-enoyl]carbamothioyl}amino)phenyl]-1-benzofuran-2-carboxamide
TL;DR: N-[2-methoxy-4-({[(2E)-3-phenylprop-2-enoyl]carbamothioyl}amino)phenyl]-1-benzofuran-2-carboxamide (CAS 429651-39-8) is a chemical compound with molecular formula C26H21N3O4S and molecular weight 471.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-methoxy-4-[[(E)-3-phenylprop-2-enoyl]carbamothioylamino]phenyl]-1-benzofuran-2-carboxamide
Also Known As: N-[2-methoxy-4-({[(2E)-3-phenylprop-2-enoyl]carbamothioyl}amino)phenyl]-1-benzofuran-2-carboxamide, N-[2-methoxy-4-[[(E)-3-phenylprop-2-enoyl]carbamothioylamino]phenyl]-1-benzofuran-2-carboxamide, N-[2-methoxy-4-(3-phenylprop-2-enoylthiocarbamoylamino)phenyl]benzofuran-2-carboxamide
| Molecular Formula | C26H21N3O4S |
|---|---|
| Molecular Weight | 471.13 g/mol |
| LogP | 5.2201 |
| Topological Polar Surface Area | 92.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 471.12527 |
| Heavy Atoms | 34 |
| Complexity | 1346.3419 |
Chemical Identifiers
| CAS Number | 429651-39-8 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)NC(=S)NC(=O)/C=C/C2=CC=CC=C2)NC(=O)C3=CC4=CC=CC=C4O3 |
Product Overview
N-[2-methoxy-4-({[(2E)-3-phenylprop-2-enoyl]carbamothioyl}amino)phenyl]-1-benzofuran-2-carboxamide (CAS 429651-39-8), with molecular formula C26H21N3O4S and molecular weight 471.13 g/mol. IUPAC: N-[2-methoxy-4-[[(E)-3-phenylprop-2-enoyl]carbamothioylamino]phenyl]-1-benzofuran-2-carboxamide.
Chemical Property Profile of N-[2-methoxy-4-({[(2E)-3-phenylprop-2-enoyl]carbamothioyl}amino)phenyl]-1-benzofuran-2-carboxamide
Property Insights of N-[2-methoxy-4-({[(2E)-3-phenylprop-2-enoyl]carbamothioyl}amino)phenyl]-1-benzofuran-2-carboxamide
The XLogP value of 5.2201 indicates that N-[2-methoxy-4-({[(2E)-3-phenylprop-2-enoyl]carbamothioyl}amino)phenyl]-1-benzofuran-2-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.6 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[2-methoxy-4-({[(2E)-3-phenylprop-2-enoyl]carbamothioyl}amino)phenyl]-1-benzofuran-2-carboxamide. Following Lipinski's Rule of Five, N-[2-methoxy-4-({[(2E)-3-phenylprop-2-enoyl]carbamothioyl}amino)phenyl]-1-benzofuran-2-carboxamide has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-[2-methoxy-4-({[(2E)-3-phenylprop-2-enoyl]carbamothioyl}amino)phenyl]-1-benzofuran-2-carboxamide?
The CAS number of N-[2-methoxy-4-({[(2E)-3-phenylprop-2-enoyl]carbamothioyl}amino)phenyl]-1-benzofuran-2-carboxamide is 429651-39-8.
What is the molecular formula of N-[2-methoxy-4-({[(2E)-3-phenylprop-2-enoyl]carbamothioyl}amino)phenyl]-1-benzofuran-2-carboxamide?
The molecular formula of N-[2-methoxy-4-({[(2E)-3-phenylprop-2-enoyl]carbamothioyl}amino)phenyl]-1-benzofuran-2-carboxamide is C26H21N3O4S.
What is the molecular weight of N-[2-methoxy-4-({[(2E)-3-phenylprop-2-enoyl]carbamothioyl}amino)phenyl]-1-benzofuran-2-carboxamide?
The molecular weight of N-[2-methoxy-4-({[(2E)-3-phenylprop-2-enoyl]carbamothioyl}amino)phenyl]-1-benzofuran-2-carboxamide is 471.13 g/mol.
Where can I buy N-[2-methoxy-4-({[(2E)-3-phenylprop-2-enoyl]carbamothioyl}amino)phenyl]-1-benzofuran-2-carboxamide?
You can request a quote for N-[2-methoxy-4-({[(2E)-3-phenylprop-2-enoyl]carbamothioyl}amino)phenyl]-1-benzofuran-2-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[2-methoxy-4-({[(2E)-3-phenylprop-2-enoyl]carbamothioyl}amino)phenyl]-1-benzofuran-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-[2-methoxy-4-({[(2E)-3-phenylprop-2-enoyl]carbamothioyl}amino)phenyl]-1-benzofuran-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.